[gmx-users] Simulation of inorganic compounds PbI2 (Lead Iodine)

Yanke Peng pengx288 at umn.edu
Wed Sep 20 17:55:39 CEST 2017

Hi to all,

I am trying to simulated the crystallization process of PbI2 in DMF.

I was wandering if you could tell me whether Gromacs is appropriate to
simulate this progress.

I have tried some crystallization process by Gromacs, such as NaCl and Urea
aqueous, but I encountered a lot of problems that I am still dealing with.

Thanks very much for your kind attention.



Yanke Peng
Visiting Ph. D Candidate
Department of Mechanical Engineering, University of Minnesota

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